Literature DB >> 15260654

Tracing the phase diagram of the four-site water potential (TIP4P).

E Sanz, C Vega, J L F Abascal, L G MacDowell.   

Abstract

We present here the phase diagram for one of the most popular water models, the four-point transferable intermolecular potential (TIP4P) model. We show that TIP4P model, does indeed provide a qualitatively correct description of the phase diagram of water. The melting line of the five-point transferable intermolecular potential (TIP5P) at low pressures is also presented.

Entities:  

Year:  2004        PMID: 15260654     DOI: 10.1063/1.1759617

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  3 in total

1.  Potential energy functions for atomic-level simulations of water and organic and biomolecular systems.

Authors:  William L Jorgensen; Julian Tirado-Rives
Journal:  Proc Natl Acad Sci U S A       Date:  2005-05-03       Impact factor: 11.205

2.  Water in cavity-ligand recognition.

Authors:  Riccardo Baron; Piotr Setny; J Andrew McCammon
Journal:  J Am Chem Soc       Date:  2010-09-01       Impact factor: 15.419

3.  Isomers and energy landscapes of micro-hydrated sulfite and chlorate clusters.

Authors:  John C Hey; Emily J Doyle; Yuting Chen; Roy L Johnston
Journal:  Philos Trans A Math Phys Eng Sci       Date:  2018-03-13       Impact factor: 4.226

  3 in total

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